In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2011 | 18 | No |
Popular Name: 5-(dimethylamino)-3-[(2,2-dimethylmorpholin-4-yl)methyl]-1,3,4-thiadiazole-2-thione 5-(dimethylamino)-3-[(2,2-dimeth…
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Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.29 | 5.18 | -9.03 | 0 | 5 | 0 | 34 | 288.442 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.29 | 7.24 | -34.36 | 1 | 5 | 1 | 35 | 289.45 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.